3,5-Dimethyl-1H-pyrrole-2-carbaldehyde
3,5-Dimethyl-1H-pyrrole-2-carbaldehyde structure
|
Common Name | 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde | ||
|---|---|---|---|---|
| CAS Number | 2199-58-8 | Molecular Weight | 123.152 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 237.3±35.0 °C at 760 mmHg | |
| Molecular Formula | C7H9NO | Melting Point | 95-99 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 103.2±33.4 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of 3,5-Dimethyl-1H-pyrrole-2-carbaldehydePYR-9588, CAS#2199-58-8, is a useful intermediate for chemical synthesis of a number of biologically important molecules, including porphyrins, bile pigments, photosensitizers, anticancer drugs. |
Summary: 3,5-dimethyl-1H-pyrrole-2-carbaldehyde (Chinese name: 3,5-二甲基-2-吡咯甲醛，CAS number: 2199-58-8)，molecular formula: C7H9NO，molecular weight: 123.152，is a yellow solid. Melting point: 95-99 °C，Boiling point: 237.3±35.0 °C. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3,5-dimethyl-1H-pyrrole-2-carbaldehyde |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 237.3±35.0 °C at 760 mmHg |
| Melting Point | 95-99 °C(lit.) |
| Molecular Formula | C7H9NO |
| Molecular Weight | 123.152 |
| Flash Point | 103.2±33.4 °C |
| Exact Mass | 123.068413 |
| PSA | 32.86000 |
| LogP | 1.56 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.577 |
| InChIKey | RDFZYUOHJBXMJA-UHFFFAOYSA-N |
| SMILES | Cc1cc(C)c(C=O)[nH]1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36/37 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2933990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde |
| 3,5-Dimethylpyrrole-2-carbaldehyde |
| 2,4-dimethylpyrrole-5-carboxaldehyde |
| 2,4-dimethylpyrrole-5-carbaldehyde |
| 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde |
| 3,5-dimethyl-pyrrole-2-carboxaldehyde |
| 3,5-DiMethyl-2-pyrrolecarboxaldehyde |
| MFCD00111522 |
| 1H-Pyrrole-2-carboxaldehyde,3,5-dimethyl |
| 2-formyl-3,5-dimethyl-1H-pyrrole |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: The English name of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is 3,5-dimethyl-1H-pyrrole-2-carbaldehyde. |
| Q: What is the molecular formula of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: Molecular formula of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is C7H9NO. |
| Q: What is the polar surface area (PSA) of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: Polar surface area (PSA) of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is 32.86000. |
| Q: What is the CAS number of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: CAS number of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is 2199-58-8. |
| Q: What is the LogP of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: LogP of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is 1.56. |
| Q: What are the uses of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: Main uses of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde: PYR-9588, CAS#2199-58-8, is a useful intermediate for chemical synthesis of a number of biologically important molecules, including porphyrins, bile pigments, photosensitizers, anticancer drugs. |
| Q: What is the boiling point of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: Boiling point of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is 237.3±35.0 °C at 760 mmHg. |
| Q: What is the InChIKey of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: InChIKey of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is RDFZYUOHJBXMJA-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde? |
| A: Molecular weight of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde is 123.152. |
| Q: What English synonyms does 3,5-dimethyl-1H-pyrrole-2-carbaldehyde have? |
| A: English synonyms of 3,5-dimethyl-1H-pyrrole-2-carbaldehyde: 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde, 3,5-Dimethylpyrrole-2-carbaldehyde, 2,4-dimethylpyrrole-5-carboxaldehyde, 2,4-dimethylpyrrole-5-carbaldehyde, 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde, 3,5-dimethyl-pyrrole-2-carboxaldehyde, 3,5-DiMethyl-2-pyrrolecarboxaldehyde, MFCD00111522, 1H-Pyrrole-2-carboxaldehyde,3,5-dimethyl, 2-formyl-3,5-dimethyl-1H-pyrrole. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |